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Compounds

COMPOUND NPA012696

STRUCTURE

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PROPERTIES

NPAID	NPA012696
CLUSTER ID	1339
NODE ID	1129
NAME	7-Carboxypenicitrinol C
FORMULA	C16H20O6
MOLECULAR WEIGHT (Da)	308.3300
ACCURATE MASS (Da)	308.1260
ORIGIN ORGANISM TYPE	Fungus
ORIGIN GENUS	Unknown-fungus
ORIGIN SPECIES	sp. SCSGAF0086
InChIKey	PKONROABJCPGSC-QNSHHTMESA-N
InChI	InChI=1S/C16H20O6/c1-6(17)5-10-12-11(7(2)9(4)22-10)8(3)14(18)13(15(12)19)16(20)21/h7,9-10,18-19H,5H2,1-4H3,(H,20,21)/t7-,9-,10+/m1/s1
SMILES	C[C@@H]1[C@H](O[C@H](C2=C1C(=C(C(=C2O)C(=O)O)O)C)CC(=O)C)C

ORIGINAL ISOLATION REFERENCE

CITATION	Nong, Xu-Hua; Zheng, Zhi-Hui; Zhang, Xiao-Yong; Lu, Xin-Hua; Qi, Shu-Hua Polyketides from a Marine-Derived Fungus Xylariaceae sp Marine Drugs 2013 11 (5) 1718-1727.
DOI	10.3390/md11051718	PMID	23697953

ORIGINAL ISOLATION TAXONOMY

RANK	NAME	DB LINK	NCBI
Domain	Eukarya	-	2759
Kingdom	Fungi	MycoBank	4751
Genus	Unknown-fungus	MycoBank	-

CLASSYFIRE

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DESCRIPTION	[[ getValue('description') ]]
KINGDOM	[[ getValue('kingdom') ]]
SUPER CLASS	[[ getValue('superclass') ]]
CLASS	[[ getValue('class') ]]
SUB CLASS	[[ getValue('subclass') ]]
MOLECULAR FRAMEWORK	[[ getValue('molecular_framework') ]]

NP CLASSIFIER

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SUPER CLASS	[[ getValue('superclass_results') ]]
CLASS	[[ getValue('class_results') ]]
PATHWAY	[[ getValue('pathway_results') ]]
IS GLYCOSIDE?	[[ getValue('isglycoside') ]]

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